Ionic Recognition Controlled by Conformational Change: A DFT Investigation.

Renato P Orenha, Ana L O Andrade, Renato G Rocha, Alvaro Muñoz Castro, Thiago F Santos, Maurício J Piotrowski, Giovanni F Caramori, Renato L T Parreira

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In one paragraph

Article in ACS omega, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

0numbers the graph read from it

0cells of the map it votes in

0citing papers in PubMed

–field-weighted citation impact

1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

0 citing papers in PubMed.

No citing paper in PubMed yet.

4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

8 authors.

Renato P OrenhaNúcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Av. Dr. Armando Salles Oliveira 201, Franca, São Paulo 14404-600, Brazil.ORCID https://orcid.org/0000-0001-7285-8098

Ana L O AndradeNúcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Av. Dr. Armando Salles Oliveira 201, Franca, São Paulo 14404-600, Brazil.

Renato G RochaNúcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Av. Dr. Armando Salles Oliveira 201, Franca, São Paulo 14404-600, Brazil.

Alvaro Muñoz CastroFacultad de Ingeniería, Arquitectura y Diseño, Universidad San Sebastián, Bellavista 7, Santiago 8420524, Chile.ORCID https://orcid.org/0000-0001-5949-9449

Thiago F SantosDepartment of Physics, Federal University of Pelotas, Pelotas, Rio Grande do Sul 96010-900, Brazil.

Maurício J PiotrowskiDepartment of Physics, Federal University of Pelotas, Pelotas, Rio Grande do Sul 96010-900, Brazil.ORCID https://orcid.org/0000-0003-3477-4437

Giovanni F CaramoriDepartamento de Química, Universidade Federal de Santa Catarina, Campus Universitário Trindade, CP 476, Florianópolis, Santa Catarina 88040-900, Brazil.ORCID https://orcid.org/0000-0002-6455-7831

Renato L T ParreiraNúcleo de Pesquisas em Ciências Exatas e Tecnológicas, Universidade de Franca, Av. Dr. Armando Salles Oliveira 201, Franca, São Paulo 14404-600, Brazil.ORCID https://orcid.org/0000-0002-5623-9833

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Ions play a crucial role in the production of important materials and are associated with various health and environmental issues. Noncovalent interactions serve as fundamental tools for controlling the availability of cations and/or anions. Herein, we investigate the ability of two conformations of the 2,6-bis(1,2,3-triazol-4-yl)pyridine molecule to recognize cations (

Identifiers

PMID40321497

DOI10.1021/acsomega.4c09597

PMCPMC12044477

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.